5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-[2-fluoro-5-(trifluoromethyl)phenyl]furan-2-carboxamide
Chemical Structure Depiction of
5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-[2-fluoro-5-(trifluoromethyl)phenyl]furan-2-carboxamide
5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-[2-fluoro-5-(trifluoromethyl)phenyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | Y501-8207 |
| Compound Name: | 5-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-[2-fluoro-5-(trifluoromethyl)phenyl]furan-2-carboxamide |
| Molecular Weight: | 426.33 |
| Molecular Formula: | C18 H14 F4 N4 O4 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(C(Nc3cc(ccc3F)C(F)(F)F)=O)o2)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9701 |
| logD: | 3.7378 |
| logSw: | -4.3444 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.535 |
| InChI Key: | SCYJPDYNKOMNRT-UHFFFAOYSA-N |